L261-0758 Screening compound: (E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine

L261-0758 Screening compound: (E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine
L261-0758 Screening compound: (E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound L261-0758
(E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

L261-0758

Molecular Formula

C16H19N3O2S2 (C16 H19 N3 O2 S2)

Compound Name

(E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine

IUPAC name

(E)-N''-methanesulfonyl-N'-{[4-(methylsulfanyl)phenyl]methyl}-N-phenylguanidine

SMILES

CSc1ccc(CN/C(/Nc2ccccc2)=N\S(C)(=O)=O)cc1

InChI

InChI=1S/C16H19N3O2S2/c1-22-15-10-8-13(9-11-15)12-17-16(19-23(2,20)21)18-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H2,17,18,19)

InChI Key

UCFXOQYGGHJRJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15121366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.937

Distribution Coefficient, logD

2.937

Water Solubility, LogSw

-3.48

Polar Surface Area

60.371

Acid Dissociation Constant (pKa)

13.96

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

L261-0758 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L261-0758 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L261-0758?
Check Price and Availability of L261-0758, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L261-0758 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L261-0758
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L261-0758
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L261-0758 available by request